N-(3-methyl-1,2-oxazol-5-yl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propanamide

Systemtic Name: N-(3-methyl-1,2-oxazol-5-yl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propanamide Openeye Name: N-(3-methylisoxazol-5-yl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propanamide CAS Name: N-(3-methyl-5-isoxazolyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]propanamide IUPAC Name: N-(3-methyl-1,2-oxazol-5-yl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propanamide Traditional Name: N-(3-methylisoxazol-5-yl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]propionamide Formula: C18H20F3N5O4 MolecularWeight: 427.37771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)NC(=O)C(C)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=C1)NC(=O)C(C)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H20F3N5O4/c1-11-9-16(30-23-11)22-17(27)12(2)24-5-7-25(8-6-24)14-4-3-13(18(19,20)21)10-15(14)26(28)29/h3-4,9-10,12H,5-8H2,1-2H3,(H,22,27)